N-(2,5-dimethylphenyl)-3-(5-sulfanylidene-1,2-dihydro-1,2,4-triazol-3-yl)propanamide

Systemtic Name: N-(2,5-dimethylphenyl)-3-(5-sulfanylidene-1,2-dihydro-1,2,4-triazol-3-yl)propanamide Openeye Name: N-(2,5-dimethylphenyl)-3-(5-thioxo-1,2-dihydro-1,2,4-triazol-3-yl)propanamide CAS Name: N-(2,5-dimethylphenyl)-3-(5-sulfanylidene-1,2-dihydro-1,2,4-triazol-3-yl)propanamide IUPAC Name: N-(2,5-dimethylphenyl)-3-(5-sulfanylidene-1,2-dihydro-1,2,4-triazol-3-yl)propanamide Traditional Name: N-(2,5-dimethylphenyl)-3-(5-thioxo-1,2-dihydro-1,2,4-triazol-3-yl)propionamide Formula: C13H16N4OS MolecularWeight: 276.35734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)CCC2=NC(=S)NN2

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)CCC2=NC(=S)NN2

InChI

InChI=1S/C13H16N4OS/c1-8-3-4-9(2)10(7-8)14-12(18)6-5-11-15-13(19)17-16-11/h3-4,7H,5-6H2,1-2H3,(H,14,18)(H2,15,16,17,19)